SCHEMBL7583241

SCHEMBL7583241

Nc1cc(S(=O)(=O)O)c2cc(S(=O)(=O)O)ccc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.62
HSD17B10 Q99714 4/20 0.62
CASP6 P55212 4/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62
NT5E P21589 4/20 0.54
NSD2 O96028 3/20 0.50
DUSP3 P51452 1/20 0.50
PTPN5 P54829 1/20 0.50
PTPN11 Q06124 1/20 0.50
TSHR P16473 2/20 0.48
TDP1 Q9NUW8 3/20 0.47
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
SENP2 Q9HC62 3/20 0.40
SUMO2 P61956 2/20 0.40
SUMO1 P63165 2/20 0.40
SENP7 Q9BQF6 2/20 0.40
SNCA P37840 2/20 0.39
RAPGEF4 Q8WZA2 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8109631 0.88 CASP6 (0.61) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL6559611 0.85 NT5E (0.57) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL11426736 0.84 NT5E (0.71) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL31398448 0.83 CASP6 (0.68) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL5292706 0.83 CASP6 (0.68) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL31398449 0.83 CASP6 (0.68) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL392126 0.83 CASP6 (0.68) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL11399290 0.82 MPL (0.47) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL31255636 0.80 ALDH1A1 (0.54) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL10424165 0.80 ALDH1A1 (0.54) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102566269-B Coloured composition, colour filter and display element JSR株式会社 2016-06-15 CN disclosed
CN-101768369-B Weather-resistant perylene bisimide dye and preparation method and application thereof UNIV DALIAN TECH 2012-05-23 CN disclosed
EP-0957135-B1 Water-soluble halotriazine-containing azo compounds, preparation thereof and use thereof as dyes DYSTAR TEXTILFARBEN GMBH & CO (DE) 2002-09-25 EP disclosed
US-6022956-A Water-soluble halotriazine-containing axo compounds, preparation thereof and use thereof as dyes DY STAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2000-02-08 US disclosed
EP-0957135-A1 Water-soluble halotriazine-containing azo compounds, preparation thereof and use thereof as dyes DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1999-11-17 EP disclosed
US-5770707-A COLORFAST REACTIVE DYES FOR COTTON SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-06-23 US disclosed
US-5596083-A CELLULOSE, POLYAMIDES, POLYURETHANES OR LEATHER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-01-21 US disclosed
EP-0728817-A2 Monoazo compounds and dyeing or printing methods using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-08-28 EP disclosed
EP-0719840-A1 Monoazo compounds and method for dyeing or printing fiber materials using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-07-03 EP disclosed
US-5128455-A WATER-SOLUBLE FIBER-REACTIVE DYES, CONTAINING AN AMINO-SUBSTITUTED 5-TRIAZINE RING WITH A FIBER-REACTIVE GROUP OF THE VINYLSULFONE SERIES HOECHST AKTIENGESELLSCHAFT (DE) 1992-07-07 US disclosed
EP-0374911-A1 Water-soluble, fibre-reactive dyes, methods for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1990-06-27 EP disclosed
EP-0212264-B1 COLOURED WATER SOLUBLE COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1989-05-31 EP disclosed
EP-0212264-A1 Coloured water soluble compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1987-03-04 EP disclosed